Geometry & MOs

Info

ID:	11629
PubChem CID:	118264
Reduced:	ClN2O2C13H15 (1)
Stoich.:	AB2C2D13E15 (1)
Weight, g/mol:	266.082205
ΔH_f, kcal/mol:	-68.7
Dipole, Da:	4.44
IP(EA), eV:	-9.95(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 3-(1-phenylethyl)imidazole-4-carboxylate;hydrochloride

Drug info:

PubChemData

Smile

CC(C1=CC=CC=C1)N2C=NC=C2C(=O)OC.Cl

DOS

IR

Vibrations